NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.2330 8.2644 123.5826 49.8184 19.0222 174.9868 3 K 3.9154 8.3461 122.9728 56.4042 36.2150 175.5267 4 H 4.1357 7.4068 113.2697 53.3829 31.8349 176.3642 5 P 4.2519 0.0000 0.0000 64.1873 30.9407 175.3714 6 V 4.5267 7.9573 120.8466 60.0102 34.9337 172.7456 7 P 4.4728 0.0000 0.0000 62.1530 31.8045 176.9585 8 K 4.1859 8.5990 123.7014 58.3898 32.6486 176.8471 9 K 4.6781 7.5141 115.5006 54.0193 36.1152 175.7567 10 K 4.1254 8.4759 122.8498 56.5414 32.8409 176.3691 11 T 4.3920 8.1709 115.3130 60.1315 70.2876 174.9101 12 S 4.2753 8.4406 119.2671 58.1232 63.8489 175.3384 13 K 3.9916 8.7801 121.4910 60.3122 31.7867 178.1697 14 A 4.0831 8.1550 121.4733 53.9296 17.9447 178.7826 15 R 3.8323 8.2472 118.7294 59.2385 30.6993 178.9240 16 R 4.0147 8.3991 118.5434 59.6431 30.0252 177.9518 17 D 4.5372 7.9368 115.6187 55.5640 40.9273 177.2852 18 A 4.5059 7.5637 120.4628 52.1738 19.5916 177.9703 19 R 4.4844 7.8720 113.4317 56.2862 30.8129 177.4465 20 R 4.2130 7.5439 118.1394 55.9117 30.3951 177.4354 21 S 4.2355 8.0151 113.6637 60.3431 63.2985 174.3288 22 H 4.8247 7.9864 116.9812 56.4087 30.2725 175.4032 23 H 4.2694 8.6766 115.9760 56.7721 28.6035 174.6199 24 A 3.9100 7.3428 121.7196 52.0315 18.0577 177.2744 25 L 4.1295 8.4454 124.3982 55.8087 42.9006 176.1641 26 T 4.6034 8.0872 114.8097 58.8126 70.6758 172.7868 27 P 4.4169 0.0000 0.0000 61.9083 31.9685 174.2135 28 P 4.3686 0.0000 0.0000 62.7548 31.9915 175.8781 29 T 4.2887 8.3538 112.1680 60.9813 69.4846 173.7830 30 L 5.0933 8.2797 125.0669 52.8993 46.0288 175.7592 31 V 4.6331 9.3262 113.7827 58.9460 36.3997 173.1883 32 P 4.7478 0.0000 0.0000 62.1212 32.0507 176.1660 33 C 4.2120 8.7084 125.7385 58.3746 31.6477 170.9505 34 P 4.3231 0.0000 0.0000 66.7438 32.5844 178.3211 35 E 4.2330 8.5184 119.5881 55.6975 28.3401 179.5344 36 C 3.8304 9.1448 116.7947 58.7589 30.6869 173.8768 37 K 4.3541 8.4999 119.0314 57.2466 32.8617 176.3404 38 A 4.6487 7.7079 120.9836 51.8623 21.4197 176.6879 39 M 4.9405 8.3622 118.3006 54.6239 33.6383 176.0822 40 K 4.8046 9.1333 120.3819 54.3809 37.3980 173.6528 41 P 4.5674 0.0000 0.0000 61.7801 32.5766 174.4950 42 P 4.2426 0.0000 0.0000 64.0479 31.7181 175.9090 43 H 4.1537 8.3803 113.2743 56.7064 26.0193 175.2585 44 T 4.4684 7.5878 110.9665 59.8430 71.6306 172.7740 45 V 3.4808 8.3838 125.7294 62.8566 30.9790 174.5864 46 C 4.1462 9.0803 125.0664 60.6651 28.2583 174.8366 47 P 3.9276 0.0000 0.0000 64.7337 32.5078 175.2010 48 E 4.3077 7.7106 118.4642 54.9577 30.2116 172.3470 49 C 3.9371 8.7406 123.7038 59.9023 25.1126 173.3057 50 G 4.0696 7.9613 111.6768 41.4238 0.0000 167.8024 51 Y 3.3523 6.9795 121.6692 58.5881 42.1307 172.8359 52 Y 5.0356 6.4847 115.8089 53.7766 40.1516 174.7472 53 A 4.6777 8.3286 134.5768 53.8860 19.1493 179.1387 54 G 3.4943 9.9219 110.4161 45.8581 0.0000 174.1971 55 R 3.6040 7.8746 126.1300 55.0364 28.8704 176.2371 56 K 3.9574 8.8583 123.3822 56.8983 32.3203 177.4832 57 V 3.4256 7.7946 117.2272 62.3790 30.8665 172.9312 58 L 4.0363 7.2203 119.0479 55.9865 41.1041 178.0424 59 E 4.3106 8.5861 119.5510 56.0305 28.2773 177.6510 60 V 3.9162 7.5470 122.8035 61.8708 31.8001 175.9224 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 A 8.26 4.23 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 K 8.35 3.92 0.00 1.81 1.74 0.00 1.66 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.15 1.54 7.81 4 H 7.41 4.14 0.00 3.24 2.51 0.00 5.79 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 P 0.00 4.25 0.00 2.17 2.08 0.00 3.76 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 6 V 7.96 4.53 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.94 0.00 0.00 7 P 0.00 4.47 0.00 2.08 1.97 0.00 3.73 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 8 K 8.60 4.19 0.00 1.70 1.83 0.00 1.63 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.41 1.52 7.81 9 K 7.51 4.68 0.00 1.72 1.63 0.00 1.82 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.34 1.36 7.81 10 K 8.48 4.13 0.00 1.71 1.71 0.00 1.76 0.00 0.00 1.75 0.00 0.00 2.84 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.43 7.81 11 T 8.17 4.39 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 12 S 8.44 4.28 0.00 4.02 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.78 3.99 0.00 1.81 1.91 0.00 1.67 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.53 1.52 7.81 14 A 8.15 4.08 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 R 8.25 3.83 0.00 1.82 2.01 0.00 3.28 0.00 0.00 3.15 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 16 R 8.40 4.01 0.00 1.87 2.11 0.00 3.13 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 17 D 7.94 4.54 0.00 2.78 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 A 7.56 4.51 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 R 7.87 4.48 0.00 2.00 2.06 0.00 3.08 0.00 0.00 3.27 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.64 0.00 20 R 7.54 4.21 0.00 1.77 1.76 0.00 3.07 0.00 0.00 3.28 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.73 0.00 21 S 8.02 4.24 0.00 3.89 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 H 7.99 4.82 0.00 3.21 3.34 0.00 5.62 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 H 8.68 4.27 0.00 3.15 3.39 0.00 5.88 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 7.34 3.91 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 L 8.45 4.13 0.00 1.63 1.59 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 26 T 8.09 4.60 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 27 P 0.00 4.42 0.00 2.20 2.10 0.00 3.77 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 28 P 0.00 4.37 0.00 2.20 2.09 0.00 3.76 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 29 T 8.35 4.29 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 30 L 8.28 5.09 0.00 1.50 1.71 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 31 V 9.33 4.63 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 1.03 0.00 0.00 32 P 0.00 4.75 0.00 1.94 1.98 0.00 3.68 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 33 C 8.71 4.21 0.00 2.95 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 P 0.00 4.32 0.00 2.28 2.20 0.00 3.83 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.03 0.00 35 E 8.52 4.23 0.00 1.99 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.26 0.00 36 C 9.14 3.83 0.00 3.08 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 K 8.50 4.35 0.00 1.86 1.93 0.00 1.45 0.00 0.00 1.71 0.00 0.00 3.15 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.49 7.81 38 A 7.71 4.65 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 M 8.36 4.94 0.00 1.91 2.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.51 0.00 40 K 9.13 4.80 0.00 1.65 1.64 0.00 1.58 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.36 1.43 7.81 41 P 0.00 4.57 0.00 2.09 2.05 0.00 3.79 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 42 P 0.00 4.24 0.00 2.34 2.09 0.00 3.69 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.15 0.00 43 H 8.38 4.15 0.00 3.25 3.59 0.00 5.69 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 T 7.59 4.47 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 45 V 8.38 3.48 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.55 0.00 0.00 46 C 9.08 4.15 0.00 3.03 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 3.93 0.00 2.20 2.14 0.00 3.71 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.01 0.00 48 E 7.71 4.31 0.00 1.89 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.25 0.00 49 C 8.74 3.94 0.00 3.15 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 G 7.96 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 Y 6.98 3.35 0.00 2.73 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 Y 6.48 5.04 0.00 2.98 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 A 8.33 4.68 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 G 9.92 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 R 7.87 3.60 0.00 1.92 1.78 0.00 3.23 0.00 0.00 3.39 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.86 0.00 56 K 8.86 3.96 0.00 1.95 2.13 0.00 1.74 0.00 0.00 1.89 0.00 0.00 3.31 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.58 1.38 7.81 57 V 7.79 3.43 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.90 0.00 0.00 58 L 7.22 4.04 0.00 1.70 1.75 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 59 E 8.59 4.31 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.30 0.00 60 V 7.55 3.92 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.93 0.00 0.00